SMILES:
COCCOc1cc2ncnc(Sc3cccc(N)c3)c2cc1OCMolecular Processing
Molecular formula
C18H19N3O3S
Molecular weight
357.44
Exact mass
357.1147
XLogP
3.4
TPSA
79.49
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
98.44
Supplementary Information
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